N-(6-methoxycyclohex-3-en-1-yl)hydroxylamine

C7H13NO2 — CID 15081075

IUPACN-(6-methoxycyclohex-3-en-1-yl)hydroxylamine
SMILESCOC1CC=CCC1NO
InChIInChI=1S/C7H13NO2/c1-10-7-5-3-2-4-6(7)8-9/h2-3,6-9H,4-5H2,1H3
InChIKeyAVZLHKISZNMVLI-UHFFFAOYSA-N
MW143.19 g/mol
LogP0.70
Rot. Bonds2

About N-(6-methoxycyclohex-3-en-1-yl)hydroxylamine

N-(6-methoxycyclohex-3-en-1-yl)hydroxylamine (PubChem CID 15081075) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is N-(6-methoxycyclohex-3-en-1-yl)hydroxylamine.

Molecular Properties

Compound NameN-(6-methoxycyclohex-3-en-1-yl)hydroxylamine
PubChem CID15081075
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC NameN-(6-methoxycyclohex-3-en-1-yl)hydroxylamine
SMILESCOC1CC=CCC1NO
InChIInChI=1S/C7H13NO2/c1-10-7-5-3-2-4-6(7)8-9/h2-3,6-9H,4-5H2,1H3
InChIKeyAVZLHKISZNMVLI-UHFFFAOYSA-N
XLogP0.70
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-(6-methoxycyclohex-3-en-1-yl)hydroxylamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-Methoxycyclohex-2-en-1-amine
CID 76223862
N,N,1,4,5,5,6-heptadeuterio-6-methoxycyclohex-2-en-1-amine
CID 141756165
6-Methoxycyclohex-3-en-1-amine
CID 163743001
(1R,6R)-6-methoxycyclohex-2-en-1-amine
CID 55285704

Frequently Asked Questions

What is the IUPAC name of N-(6-methoxycyclohex-3-en-1-yl)hydroxylamine?
The IUPAC name of N-(6-methoxycyclohex-3-en-1-yl)hydroxylamine (CID 15081075) is N-(6-methoxycyclohex-3-en-1-yl)hydroxylamine.
What is the SMILES notation for N-(6-methoxycyclohex-3-en-1-yl)hydroxylamine?
The canonical SMILES for N-(6-methoxycyclohex-3-en-1-yl)hydroxylamine is COC1CC=CCC1NO.
What is the InChIKey of N-(6-methoxycyclohex-3-en-1-yl)hydroxylamine?
The InChIKey is AVZLHKISZNMVLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2/c1-10-7-5-3-2-4-6(7)8-9/h2-3,6-9H,4-5H2,1H3.
What are the key properties of N-(6-methoxycyclohex-3-en-1-yl)hydroxylamine?
N-(6-methoxycyclohex-3-en-1-yl)hydroxylamine has a molecular weight of 143.19 g/mol, XLogP of 0.70, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxycyclohex-3-en-1-yl)hydroxylamine is sourced from PubChem (CID 15081075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).